NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 V 4.0121 8.0501 120.3129 61.4806 33.0000 174.5093 5 A 4.4111 8.1292 125.7139 49.4370 20.2800 175.6042 6 F 2.9131 8.6889 123.5254 59.8232 40.4507 174.0975 7 G 3.4617 7.5021 115.0206 45.0746 0.0000 173.6095 8 S 4.1028 7.3053 116.3699 58.2362 63.3344 175.3234 9 E 3.9833 8.7568 124.7785 58.4177 29.7641 176.9664 10 D 5.0685 7.7001 117.8984 52.3947 40.2349 177.6444 11 I 3.4847 7.5396 122.6836 65.2699 37.8314 176.8263 12 E 4.0607 8.1238 117.7590 59.1831 29.2293 178.9031 13 N 4.3656 8.0060 117.0526 56.5682 38.8324 177.1609 14 T 4.0106 7.7549 116.5805 66.7294 68.6738 176.6563 15 L 3.9989 8.0730 120.3545 57.2191 41.3407 179.1937 16 A 4.2765 7.8391 119.7994 54.6760 18.3564 178.8197 17 K 4.2400 7.6947 114.7007 56.4226 32.9073 176.6141 18 M 4.5057 7.4450 119.9313 53.9811 33.6167 176.4600 19 D 4.8569 8.1702 122.4589 52.3239 43.3170 176.7192 20 D 4.4748 8.6051 118.0581 57.8696 40.5883 178.9214 21 G 3.6863 8.1001 104.2844 47.9739 0.0000 175.2672 22 Q 4.1407 8.5121 120.3867 58.7151 28.8993 178.7020 23 L 3.9728 8.2680 120.3479 57.9150 41.4656 179.1700 24 D 4.6132 8.5271 117.8716 56.1638 40.8353 177.8589 25 G 3.8436 7.6901 104.6799 43.9783 0.0000 174.1332 26 L 3.8687 6.8151 120.4628 54.4044 42.0277 177.3546 27 A 4.1590 8.0716 123.5251 53.6152 18.8469 177.3492 28 F 5.1249 6.7151 109.6068 54.3018 41.4097 175.3641 29 G 4.3471 9.3645 107.3465 46.1175 0.0000 172.6223 30 A 5.4899 9.4671 124.9993 50.3935 22.6775 174.9759 31 I 4.9630 9.1043 123.8094 59.5331 40.9185 174.4338 32 Q 4.7795 8.8896 127.1243 54.1986 31.3085 174.2009 33 L 5.3373 8.9700 126.2023 52.9131 45.4600 176.3911 34 D 5.6367 8.2925 121.4346 51.5756 40.9664 177.5315 35 G 3.6463 9.1331 107.8628 48.4195 0.0000 174.2896 36 D 4.6814 8.4991 117.4517 54.4328 41.3977 177.1615 37 G 4.0421 8.9149 108.8235 45.4415 0.0000 173.1244 38 N 4.9125 8.5134 117.7206 52.6778 39.3864 174.3307 39 I 4.3251 8.6486 124.0461 61.3881 37.6013 176.5566 40 L 4.2770 9.1409 128.0530 56.5946 42.8268 177.2639 41 Q 4.7199 7.7231 115.2083 54.8903 33.7459 173.9309 42 Y 5.0075 8.4382 122.1630 57.1169 41.5119 173.9023 43 N 5.0255 8.7778 125.2521 51.6844 39.8469 176.2482 44 A 4.0602 8.8929 120.3444 55.2245 18.0580 179.7608 45 A 3.9793 7.8964 118.0497 55.1374 18.7846 179.2167 46 Q 4.1459 8.2919 117.8237 59.4257 29.1716 178.6373 47 G 3.8967 8.0870 106.2216 47.9050 0.0000 175.3500 48 D 4.4259 8.1040 120.3246 57.0844 40.8057 178.4064 49 I 4.0820 7.6888 120.1505 63.4878 37.4597 177.3706 50 T 4.5828 8.0696 107.4783 60.7859 69.9195 175.5258 51 G 3.9449 8.2893 109.5052 45.6946 0.0000 173.6643 52 R 4.2035 7.5994 118.0468 54.9452 31.2228 175.8505 53 D 4.5351 8.4007 121.3989 53.1541 41.3637 175.3013 54 P 4.2215 0.0000 0.0000 65.4755 31.4209 178.4586 55 K 4.1546 8.3824 116.5216 58.4314 32.0352 178.2716 56 Q 4.4472 7.7535 116.2545 56.3928 30.2277 177.5662 57 V 3.7235 7.3941 112.3717 61.6431 31.7212 176.0082 58 I 3.8780 7.1389 120.1118 62.9411 37.2790 175.8932 59 G 3.9909 9.0358 114.5048 45.2759 0.0000 174.0157 60 K 4.1825 7.7744 119.0176 55.7310 33.1164 175.2803 61 N 5.0050 8.3034 119.1126 52.2791 39.8344 175.4688 62 F 3.8214 9.0177 129.0368 61.2331 39.6153 177.1653 63 F 3.7707 7.5852 117.3104 59.4864 39.1864 176.8060 64 K 4.0388 8.3804 121.0831 58.4581 32.4323 176.7511 65 D 4.6274 7.9081 115.9155 55.7576 42.4955 177.8904 66 V 3.6541 7.4931 116.3789 64.7485 32.5496 175.9554 67 A 4.3661 7.2973 121.0391 49.5744 18.5312 174.8062 68 P 4.1880 0.0000 0.0000 64.8665 32.0319 179.3635 69 C 4.2816 7.8598 112.9421 60.5472 29.8434 174.2458 70 T 4.1480 7.8090 109.9825 62.1384 68.7888 174.1945 71 D 5.2353 7.7432 123.2264 53.0711 39.6572 174.8488 72 S 4.7417 8.0253 116.8413 56.2392 65.2815 175.1342 73 P 4.2110 0.0000 0.0000 65.8148 31.2201 178.7553 74 E 4.0000 8.2603 116.2042 58.1397 29.2703 175.7418 75 F 4.4568 7.3837 117.6535 58.6676 42.3471 175.7768 76 Y 4.1233 9.0675 120.4473 60.8098 38.7726 179.1057 77 G 3.6137 8.3032 107.9973 47.2575 0.0000 175.8289 78 K 4.2696 7.9360 121.9104 58.2728 32.0019 179.0497 79 F 4.1425 8.5487 121.3713 61.3336 39.4113 177.4444 80 K 3.7532 8.3572 118.5547 59.7792 32.4249 178.8970 81 E 3.9603 8.1486 120.0641 59.2435 29.4651 179.5553 82 G 3.6054 7.9631 105.7598 47.3902 0.0000 176.0217 83 V 3.0888 7.2702 119.7765 65.6142 31.5027 177.7367 84 A 4.0727 7.6569 119.4829 55.1101 18.3440 179.4527 85 S 4.2625 8.0615 111.3145 59.1672 63.3554 175.6411 86 G 3.9036 7.7971 109.3595 45.9122 0.0000 173.2172 87 N 4.7725 7.7905 115.2207 52.5314 39.3345 173.5361 88 L 3.7809 7.6909 119.1010 56.3805 42.9354 175.5626 89 N 4.9843 8.6572 119.8180 53.6654 40.6821 172.8232 90 T 4.8723 9.1521 120.2104 60.7462 71.5623 172.0090 91 M 5.4468 8.4993 126.1094 53.8072 35.8846 174.3669 92 F 4.8860 8.4445 115.9823 56.4729 41.8250 172.6755 93 E 5.0279 8.9363 118.7864 56.0374 31.2424 174.7292 94 Y 4.8093 8.5899 121.5073 57.3785 43.2537 173.0069 95 T 5.0577 7.9958 118.5254 61.7367 71.5556 173.5046 96 F 5.4670 9.1977 125.8060 55.9207 40.9754 176.7148 97 D 4.7649 8.8017 119.8723 53.7871 39.7389 173.9048 98 Y 4.4652 8.2130 122.1632 57.7131 39.1978 175.2654 99 Q 3.4220 8.2113 127.4183 56.1153 26.5028 173.1418 100 M 4.7039 7.1212 111.2155 54.1687 34.3515 174.4683 101 T 3.9796 8.3102 116.8930 62.9040 69.1647 172.7101 102 P 4.6546 0.0000 0.0000 63.6333 32.0959 175.8902 103 T 4.6347 8.9682 120.5505 61.5977 72.6199 173.4706 104 K 4.5788 8.6965 126.4674 56.4669 33.6385 176.6128 105 V 4.8975 8.8775 117.0092 59.6329 36.9469 173.8321 106 K 4.9568 8.8437 123.1833 54.7007 34.6868 174.8756 107 V 5.0092 8.7461 126.6553 61.2719 34.7995 173.6107 108 H 5.2260 9.4070 126.7908 54.8222 32.7686 171.6395 109 M 5.1128 9.1713 126.2488 53.7485 34.4916 175.2437 110 K 5.1271 8.9196 123.3947 54.5986 36.3274 175.0355 111 K 4.4056 9.0162 129.0572 56.9737 32.6748 176.3238 112 A 4.6257 8.1253 128.6454 51.3396 19.1489 177.7600 113 L 4.0929 8.6656 119.3261 57.5534 42.0510 178.7399 114 S 4.3372 7.7949 111.6187 57.3173 63.8124 173.9961 115 G 3.5078 8.3572 110.8564 46.9255 0.0000 173.0617 116 D 4.3774 8.6605 121.9148 54.8878 40.0206 172.7867 117 S 4.8882 6.8583 110.4350 56.7491 67.3051 173.1545 118 Y 4.8977 8.6261 119.2435 56.2173 42.1173 174.4815 119 W 4.8512 9.2400 124.8270 56.0594 31.0738 175.5793 120 V 4.5904 8.8487 123.6709 61.2375 33.6307 174.1138 121 F 5.8317 9.1767 127.2135 56.0004 41.9888 175.0486 122 V 5.2986 9.3534 121.7079 61.3303 35.2231 174.1071 123 K 4.9039 8.6834 125.1451 54.8656 36.2551 175.8789 124 R 4.4701 8.5270 120.2894 56.3949 31.0383 177.2660 125 V 3.9384 7.9629 114.2278 61.6429 32.3321 175.6872 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 4 V 8.05 4.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.87 0.00 0.00 5 A 8.13 4.41 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.69 2.91 0.00 2.57 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.50 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 7.31 4.10 0.00 3.73 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.76 3.98 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 10 D 7.70 5.07 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.54 3.48 1.67 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.95 0.78 0.00 0.00 12 E 8.12 4.06 0.00 2.44 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 13 N 8.01 4.37 0.00 2.91 2.92 0.00 0.00 7.04 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 7.75 4.01 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 15 L 8.07 4.00 0.00 1.48 1.30 0.78 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.84 4.28 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.69 4.24 0.00 1.84 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.68 7.81 18 M 7.44 4.51 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.45 0.00 19 D 8.17 4.86 0.00 2.92 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.61 4.47 0.00 2.77 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.10 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.51 4.14 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 23 L 8.27 3.97 0.00 1.87 1.79 1.16 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.53 4.61 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.69 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 6.82 3.87 0.00 1.25 0.48 0.60 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.07 4.16 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 6.72 5.12 0.00 3.34 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 9.36 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 9.47 5.49 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 9.10 4.96 1.67 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.44 0.81 0.00 0.00 32 Q 8.89 4.78 0.00 1.42 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 1.79 1.24 0.00 33 L 8.97 5.34 0.00 1.77 1.58 0.19 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.29 5.64 0.00 3.24 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 9.13 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.50 4.68 0.00 2.92 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.91 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.51 4.91 0.00 3.08 2.75 0.00 0.00 7.03 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.65 4.33 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.84 1.03 0.00 0.00 40 L 9.14 4.28 0.00 1.46 1.64 0.84 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 7.72 4.72 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 42 Y 8.44 5.01 0.00 2.94 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 N 8.78 5.03 0.00 3.04 3.00 0.00 0.00 6.44 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.89 4.06 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 7.90 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Q 8.29 4.15 0.00 2.04 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 1.38 2.10 0.00 47 G 8.09 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.10 4.43 0.00 2.91 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.69 4.08 2.14 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.67 1.08 0.00 0.00 50 T 8.07 4.58 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 51 G 8.29 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 R 7.60 4.20 0.00 1.89 1.64 0.00 3.26 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 53 D 8.40 4.54 0.00 2.73 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.22 0.00 2.16 2.60 0.00 3.78 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.46 0.00 55 K 8.38 4.15 0.00 1.84 1.87 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.49 7.81 56 Q 7.75 4.45 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.98 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 57 V 7.39 3.72 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 -0.00 0.00 0.00 58 I 7.14 3.88 1.85 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.74 0.96 0.00 0.00 59 G 9.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.77 4.18 0.00 1.89 1.67 0.00 1.56 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.40 7.81 61 N 8.30 5.00 0.00 2.80 2.63 0.00 0.00 6.51 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 9.02 3.82 0.00 2.73 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 F 7.59 3.77 0.00 2.48 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.38 4.04 0.00 1.67 1.75 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.35 7.81 65 D 7.91 4.63 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.49 3.65 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.81 0.00 0.00 67 A 7.30 4.37 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.19 0.00 1.89 1.93 0.00 3.43 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.60 0.00 69 C 7.86 4.28 0.00 3.24 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.81 4.15 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 71 D 7.74 5.24 0.00 2.77 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.03 4.74 0.00 4.29 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.21 0.00 2.21 2.14 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 74 E 8.26 4.00 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 75 F 7.38 4.46 0.00 2.68 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 9.07 4.12 0.00 2.96 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.30 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.94 4.27 0.00 1.90 1.88 0.00 1.45 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.20 7.81 79 F 8.55 4.14 0.00 3.40 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.36 3.75 0.00 1.90 1.87 0.00 1.12 0.00 0.00 1.50 0.00 0.00 2.82 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.07 1.59 7.81 81 E 8.15 3.96 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 82 G 7.96 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 V 7.27 3.09 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 -0.73 0.00 0.00 84 A 7.66 4.07 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.06 4.26 0.00 4.03 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.80 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 N 7.79 4.77 0.00 2.70 2.78 0.00 0.00 6.98 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.69 3.78 0.00 1.82 1.71 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.66 4.98 0.00 2.75 2.71 0.00 0.00 6.94 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 9.15 4.87 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 91 M 8.50 5.45 0.00 1.87 1.91 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.30 0.00 92 F 8.44 4.89 0.00 3.10 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.94 5.03 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 94 Y 8.59 4.81 0.00 3.37 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 8.00 5.06 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 96 F 9.20 5.47 0.00 3.01 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.80 4.76 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 8.21 4.47 0.00 2.96 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.21 3.42 0.00 1.80 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.51 0.00 0.00 0.00 0.00 0.00 1.69 1.16 0.00 100 M 7.12 4.70 0.00 2.40 2.05 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.77 0.00 101 T 8.31 3.98 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 102 P 0.00 4.65 0.00 1.96 2.05 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 103 T 8.97 4.63 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 104 K 8.70 4.58 0.00 1.69 1.70 0.00 1.60 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.47 7.81 105 V 8.88 4.90 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.23 0.00 0.00 106 K 8.84 4.96 0.00 1.68 1.37 0.00 1.55 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.37 7.81 107 V 8.75 5.01 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.89 0.00 0.00 108 H 9.41 5.23 0.00 2.80 2.83 0.00 5.63 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 M 9.17 5.11 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 110 K 8.92 5.13 0.00 1.75 1.75 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.65 7.81 111 K 9.02 4.41 0.00 1.94 1.78 0.00 1.93 0.00 0.00 1.73 0.00 0.00 2.70 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.23 7.81 112 A 8.13 4.63 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.67 4.09 0.00 1.71 1.77 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 114 S 7.79 4.34 0.00 3.91 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.36 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.66 4.38 0.00 2.89 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 6.86 4.89 0.00 3.51 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 8.63 4.90 0.00 3.24 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 W 9.24 4.85 0.00 2.90 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.85 4.59 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.88 0.00 0.00 121 F 9.18 5.83 0.00 2.93 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 V 9.35 5.30 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.27 0.00 0.00 123 K 8.68 4.90 0.00 1.56 1.40 0.00 1.00 0.00 0.00 0.83 0.00 0.00 2.28 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.87 7.81 124 R 8.53 4.47 0.00 1.68 1.87 0.00 3.14 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 125 V 7.96 3.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.91 0.00 0.00